D03BAB
-OEChem-10101305022D
65 68 0 1 0 0 0 0 0999 V2000
4.2701 1.0947 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0677 3.9094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6064 2.1882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0382 5.4040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.2701 -2.3694 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.1361 -2.8694 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
7.1361 -3.8694 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.4041 -2.8694 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.2701 -4.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4041 -3.8694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0301 -2.3347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7701 -1.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0301 -4.4040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7701 -1.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1361 -4.8694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9361 -2.8486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5380 -2.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9361 -3.8902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2701 -0.6373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0185 -5.4040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7701 0.2287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7701 0.2287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2701 1.0947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7701 1.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7701 1.9608 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.2701 2.8268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2756 2.9313 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.6768 3.7403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9337 4.4094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1296 -2.0194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
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6.6686 -4.8443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7935 -3.7617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1920 -4.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4237 -1.8557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6255 -1.8649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2952 -1.1048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2952 -1.9019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3070 -1.8134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0801 -0.9664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2332 -1.1934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5161 -4.8694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1361 -5.4894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7561 -4.8694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5470 -2.9546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1452 -2.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8480 -1.8324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0011 -2.0594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2280 -2.9063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4719 -4.2023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7450 -1.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7450 -0.2388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3986 -5.3968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0113 -6.0239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6385 -5.4111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1875 0.0166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8778 -0.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8901 1.0947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3527 2.1728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6624 2.5713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0801 2.4977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6767 3.0918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2833 3.8692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.3171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 22 1 0 0 0 0
1 25 1 0 0 0 0
2 27 1 0 0 0 0
2 29 1 0 0 0 0
27 3 1 6 0 0 0
3 65 1 0 0 0 0
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7 9 1 0 0 0 0
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7 15 1 1 0 0 0
8 10 1 0 0 0 0
8 17 1 6 0 0 0
8 31 1 0 0 0 0
9 10 1 0 0 0 0
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14 40 1 0 0 0 0
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28 29 1 0 0 0 0
28 64 1 0 0 0 0
M END
$$$$